4-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzonitrile CAS Name: 4-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzonitrile IUPAC Name: 4-[(E)-4-(4-pentylcyclohexyl)but-1-enyl]benzonitrile Traditional Name: 4-[(E)-4-(4-amylcyclohexyl)but-1-enyl]benzonitrile Formula: C22H31N MolecularWeight: 309.48824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CC/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H31N/c1-2-3-4-7-19-10-12-20(13-11-19)8-5-6-9-21-14-16-22(18-23)17-15-21/h6,9,14-17,19-20H,2-5,7-8,10-13H2,1H3/b9-6+